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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037483

Kutzneride 9

Formula: C37H47Cl2N7O12  |  Mol. Weight: 852.70 g/mol

IUPAC: (3S)-3-[(1S,4R,7S,14S,17S,20R,23S,31R)-7-tert-butyl-26,27-dichloro-31-hydroxy-17-(methoxymethyl)-4-(1-methylcyclopropyl)-2,5,8,15,18,21-hexaoxo-6-oxa-3,9,10,16,19,22,24-heptazapentacyclo[20.10.0.09,14.023,31.025,30]dotriaconta-10,25(30),26,28-tetraen-20-yl]-3-hydroxypropanoic acid

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Overview

Molecular Formula C37H47Cl2N7O12
Molecular Weight 852.70 g/mol
Canonical SMILES CC1(CC1)C2C(=O)OC(C(=O)N3C(CCC=N3)C(=O)NC(C(=O)NC(C(=O)N4C(CC5(C4NC6=C5C=CC(=C6Cl)Cl)O)C(=O)N2)C(CC(=O)O)O)COC)C(C)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy